Name: 1-(3-bromo-4-fluorophenyl)-1-(2-tetrahydropyrimidinyl)methanol
SMILES:
OC(c1ccc(F)c(Br)c1)C1NC=CCN1Molecular Processing
Molecular formula
C11H12BrFN2O
Molecular weight
287.13
Exact mass
286.0117
XLogP
1.65
TPSA
44.29
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
63.13
Supplementary Information
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